ChemSpider 2D Image | GEMFIBROZIL-D6 | C15H16D6O3

GEMFIBROZIL-D6

  • Molecular FormulaC15H16D6O3
  • Average mass256.370 Da
  • Monoisotopic mass256.194550 Da
  • ChemSpider ID23936204

  • Non-standard isotope - Non-standard isotope

More details:

Validated by Experts, Validated by Users, Non-Validated, Removed by Users

1184986-45-5 [RN]
5-(2,5-Dimethylphenoxy)-2,2-bis[(2H3)methyl]pentanoic acid [ACD/IUPAC Name]
5-(2,5-Dimethylphenoxy)-2,2-bis[(2H3)methyl]pentansäure [German] [ACD/IUPAC Name]
Acide 5-(2,5-diméthylphénoxy)-2,2-bis[(2H3)méthyl]pentanoïque [French] [ACD/IUPAC Name]
GEMFIBROZIL-D6
Pentanoic acid, 5-(2,5-dimethylphenoxy)-2,2-di(methyl-d3)- [ACD/Index Name]
2,2-Dimethyl-5-(2,5-dimethylphenoxy)pentanoic acid
Gemfibrozil-d6 (2,2-dimethyl-d6)

    Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

    Density: 1.0±0.1 g/cm3
    Boiling Point: 394.7±30.0 °C at 760 mmHg
    Vapour Pressure: 0.0±1.0 mmHg at 25°C
    Enthalpy of Vaporization: 68.0±3.0 kJ/mol
    Flash Point: 141.6±18.1 °C
    Index of Refraction: 1.512
    Molar Refractivity: 71.9±0.3 cm3
    #H bond acceptors: 3
    #H bond donors: 1
    #Freely Rotating Bonds: 6
    #Rule of 5 Violations: 0
    ACD/LogP: 4.39
    ACD/LogD (pH 5.5): 3.37
    ACD/BCF (pH 5.5): 137.10
    ACD/KOC (pH 5.5): 690.52
    ACD/LogD (pH 7.4): 1.58
    ACD/BCF (pH 7.4): 2.19
    ACD/KOC (pH 7.4): 11.03
    Polar Surface Area: 47 Å2
    Polarizability: 28.5±0.5 10-24cm3
    Surface Tension: 37.9±3.0 dyne/cm
    Molar Volume: 239.7±3.0 cm3

    Click to predict properties on the Chemicalize site


    Advertisement